Pivalonitrile 三甲基乙腈

CAS 630-18-2 MFCD00001847

化学结构图

630-18-2
SMILES: CC(C)(C)C#N

化学属性

Mol. FormulaC5H9N
Mol. Weight83.13
Refractive index1.3770 to 1.3790
Boiling Point105-106 °C at 760 mmHg
Density0.752
Melting Point15 °C
Flash Point21°C(lit.)
TSCAYes

别名和识别编码

Chemical NamePivalonitrile
Synonym Trimethylacetonitrile {LY} Trimethylacetonitrile {} {LY} Trimethylacetonitrile {} {} {LY} Trimethylacetonitrile {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} Trimethylacetonitrile {} {} {} {} {} {} {} {} {} {} {} {} {}
CAS Number630-18-2
PubChem Substance ID87574657
EC Number211-133-0
Beilstein Registry Number1361449
MDL NumberMFCD00001847
Reaxys-RN1361449
Chemical Name Translation三甲基乙腈
InChIKeyJAMNHZBIQDNHMM-UHFFFAOYSA-N
LabNetwork Molecule IDLN00195684
InChIInChI=1S/C5H9N/c1-5(2,3)4-6/h1-3H3
Canonical SMILESCC(C)(C)C#N
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分类

  • Building Blocks, C1 to C5, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks
  • {uni_hamburg} no charge; 1fragment
  • {SNA} Building Blocks, C1 to C5, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks
  • {SA} Building Blocks, C1 to C5, Chemical Synthesis, Cyanides/Nitriles, Nitrogen Compounds, Organic Building Blocks

相关文献及参考

  • For in situ reaction with vinyl triflates in the synthesis of sterically hindered 2,4,6-trisubstituted pyrimidines, see: Synthesis, 881 (1990); for reaction scheme, see Trifluoromethanesulfonic acid, A10173.
  • Short: II/19a

安全信息

GHS Symbol
WGK Germany3
Hazard statements
  • H225 Highly flammable liquid and vapour 高度易燃液体和蒸气
  • H301 Toxic if swallowed 吞食有毒
  • H311 Toxic in contact with skin 皮肤接触中毒
  • H331 Toxic if inhaled 吸入中毒
Personal Protective Equipment Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
Hazard Codes 3 F,T F,T,Xi F;T
Precautionary statements
  • P210 Keep away from heat/sparks/open flames/hot surfaces. — No smoking. 远离热源/火花/明火/热的表面。——禁止吸烟。
  • P233 Keep container tightly closed. ?保持容器密闭。
  • P240 Ground/bond container and receiving equipment. 与地面接触/连接集装箱和接受设备。
  • P241+P242+P243
  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray. 避免吸入粉尘/烟/气体/烟雾/蒸汽/喷雾。
  • P264 Wash hands thoroughly after handling. 处理后要彻底洗净双手。
  • P270 Do not eat, drink or smoke when using this product. 使用本产品时不要吃东西,喝水或吸烟。
  • P271 Use only outdoors or in a well-ventilated area.? 只能在室外或通风良好的地方使用。
  • P280 Wear protective gloves/protective clothing/eye protection/face protection. 戴防护手套/防护服/眼睛的保护物/面部保护物。
  • P301+P310
  • P301+P312+P330
  • P302+P352+P312+P362+P364
  • P303+P361+P353
  • P304+P340+P312
  • P305+P351+P338+P337+P313
  • P332+P313
  • P337+P313
  • P370+P378
  • P403+P235
  • P501 Dispose of contents/container to..… 处理内容物/容器.....
Signal word Danger
UN Number 1993 UN 1993 3/PG 2 UN3273
Safety Statements
  • S16 Keep away from sources of ignition - No smoking 远离火源,禁止吸烟;
  • S36/37/39 Wear suitable protective clothing, gloves and eye/face protection 穿戴适当的防护服、手套和眼睛/面保护;
  • S45 In case of accident or if you feel unwell seek medical advice immediately (show the label where possible) 发生事故时或感觉不适时,立即求医(可能时出示标签);
Risk Statements
  • R11 Highly flammable 非常易燃
  • R20/21/22 Harmful by inhalation, in contact with skin and if swallowed 吸入、皮肤接触和不慎吞咽有害
  • R23/24/25 Toxic by inhalation, in contact with skin and if swallowed 吸入,皮肤接触及吞食都有毒
  • R36/37/38 Irritating to eyes, respiratory system and skin 对眼睛、呼吸系统和皮肤有刺激性
Packing GroupII
Hazard Class3
Storage condition 2-8°C, stored under nitrogen {LY} 2-8°C, stored under nitrogen {} {LY} 2-8°C, stored under nitrogen {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} { {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {} {LY} 2-8°C, stored under nitrogen {} {} {} {} {} {} {} {} {} {} {} {} {}

其他信息

  • 上游原料:乙醇 --> 氢氧化钠 --> 氢氧化铵 --> 丙酮 --> 盐酸羟胺 --> 五氧化二磷 --> 三甲基乙酰氯
  • Alfa Aesar:三甲基乙腈,98+% Trimethylacetonitrile, 98+%(630-18-2)
  • F:19
  • Acros Organics:三甲基乙腈 Trimethylacetonitrile, 98%(630-18-2)
  • Hazard Note:Irritant
  • Sigma Aldrich:630-18-2(sigmaaldrich)
  • 三甲基乙腈价格(试剂级):更新日期 产品编号 产品名称 包装 价格 2014/06/02 P0463 新戊腈 Pivalonitrile 500ML 6610元 2014/06/02 P0463 新戊腈 Pivalonitrile 25ML 782元 2010/06/21 140031000 三甲基乙腈 Trimethylacetonitrile 98% 100 ML 2604元
  • TCI Shanghai:新戊腈 Pivalonitrile,>;98.0%(GC)(630-18-2)
  • 图谱信息:三甲基乙腈(630-18-2)核磁图( 1 HNMR) 三甲基乙腈(630-18-2)红外图谱(IR1) 三甲基乙腈(630-18-2)质谱(MS) 三甲基乙腈(630-18-2)核磁图( 13 CNMR) 三甲基乙腈(630-18-2)Raman光谱
  • 下游产品:三甲基乙酸
  • MOL 文件:630-18-2.mol

系列性分类


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